Chemical ID: 4575015

Cc1ccc2c(c1)c(=O)c3c(o2)C(=O)N(C3c4ccc(cc4)C(C)C)CCc5ccc(cc5)OC
Chemical ID:
4575015
Name [?]:
None
SMILES [?]:
Cc1ccc2c(c1)c(=O)c3c(o2)C(=O)N(C3c4ccc(cc4)C(C)C)CCc5ccc(cc5)OC
InChi [?]:
InChI=1/C30H29NO4/c1-18(2)21-8-10-22(11-9-21)27-26-28(32)24-17-19(3)5-14-25(24)35-29(26)30(33)31(27)16-15-20-6-12-23(34-4)13-7-20/h5-14,17-18,27H,15-16H2,1-4H3
InChi Info:
AuxInfo=1/0/N:24,25,1,35,3,29,33,19,21,18,22,30,32,4,27,26,7,23,2,28,20,17,31,6,5,10,16,8,11,13,15,9,14,34,12/E:(1,2)(6,7)(8,9)(10,11)(12,13)/rA:35cCCCCCCCCOCCOCONCCCCCCCCCCCCCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s8;d10;s5s11;s11;d13;s13;s10s15;s16;s17;d18;s19;d20;d17s21;s20;s23;s23;s15;s26;s27;s28;d29;s30;d31;d28s32;s31;s34;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C30H29NO4
All Atoms:35
Heavy Atoms:35
Chiral Atoms:1
ZAP Information [?]
Total:13.5095
Area:722.32
Solvation:-4.54851
Coulombic:-44.9093
Bond Count [?]
All:39
Single:27
Double:12
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:467.556
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:6.04
LogP (Chemaxon):6.09

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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